(3,4-Difluorophenyl)acetic acid → N-[(3RS,4SR)-1-(1-cyclopropylmethyl-piperidine-4-carbonyl)-4-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-2-(3,4-difluoro-phenyl)-N-methyl-acetamide

HRID 679205Notes

Reaction equation

HRID 679205 reaction equation
[CH:1]1([CH2:4][N:5]2[CH2:6][CH2:7][CH:8]([C:11](=[O:12])[N:13]3[CH2:14][CH:15]([c:20]4[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]4)[CH:16]([NH:18][CH3:19])[CH2:17]3)[CH2:9][CH2:10]2)[CH2:2][CH2:3]1.[F:28][c:29]1[cH:30][c:31]([CH2:36][C:37](=[O:38])[OH:39])[cH:32][cH:33][c:34]1[F:35]>>[CH:1]1([CH2:4][N:5]2[CH2:6][CH2:7][CH:8]([C:11](=[O:12])[N:13]3[CH2:14][CH:15]([c:20]4[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]4)[CH:16]([N:18]([CH3:19])[C:37]([CH2:36][c:31]4[cH:30][c:29]([F:28])[c:34]([F:35])[cH:33][cH:32]4)=[O:39])[CH2:17]3)[CH2:9][CH2:10]2)[CH2:2][CH2:3]1

Participants

3

Reactant 2

HCID 69571(3,4-Difluorophenyl)acetic acidHCID 67025771(1-cyclopropylmethyl-piperidin-4-yl)-[(3SR,4RS)-3-(3,4-dichloro-phenyl)-4-methylamino-pyrrolidin-1-yl]-methanone

Product 1

HCID 67025923N-[(3RS,4SR)-1-(1-cyclopropylmethyl-piperidine-4-carbonyl)-4-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-2-(3,4-difluoro-phenyl)-N-methyl-acetamide

Sources & evidence

ORD record
ord-9dec9aedd5b04e4c985cd4211afb4499
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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